N-(2,5-dimethylphenyl)-3-(2-oxidanylidene-1,3-benzothiazol-3-yl)propanamide

Systemtic Name: N-(2,5-dimethylphenyl)-3-(2-oxidanylidene-1,3-benzothiazol-3-yl)propanamide Openeye Name: N-(2,5-dimethylphenyl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide CAS Name: N-(2,5-dimethylphenyl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide IUPAC Name: N-(2,5-dimethylphenyl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide Traditional Name: N-(2,5-dimethylphenyl)-3-(2-keto-1,3-benzothiazol-3-yl)propionamide Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CCN2C3=CC=CC=C3SC2=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CCN2C3=CC=CC=C3SC2=O

InChI

InChI=1S/C18H18N2O2S/c1-12-7-8-13(2)14(11-12)19-17(21)9-10-20-15-5-3-4-6-16(15)23-18(20)22/h3-8,11H,9-10H2,1-2H3,(H,19,21)